N-(5-cyano-2-pyridinyl)-2-[1-(2,3-dichlorophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]oxy-3-(2-hydroxyethoxy)propanamide

HCID 76550422
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Basic information

Standard SMILES
N#Cc1ccc(NC(=O)C(COCCO)Oc2ncnc3c2cnn3-c2cccc(Cl)c2Cl)nc1
InChIKey
HVHCJLIELJQWEU-UHFFFAOYSA-N
Molecular formula
C22H17Cl2N7O4
Average molar mass
514.3 g/mol

Names & identifiers

Preferred name
N-(5-cyano-2-pyridinyl)-2-[1-(2,3-dichlorophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]oxy-3-(2-hydroxyethoxy)propanamide
IUPAC
N-(5-cyano-2-pyridinyl)-2-[1-(2,3-dichlorophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]oxy-3-(2-hydroxyethoxy)propanamide

Database identifiers

PubChem CID
76550422

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
148 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
9
Rotatable bonds
9
Heavy atoms
35

Related reactions

1 records
New reaction record

Compound notes

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N-(5-cyano-2-pyridinyl)-2-[1-(2,3-dichlorophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]oxy-3-(2-hydroxyethoxy)propanamide (HCID 76550422)｜Huagongshe